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	hartrees
Energy at 0K	-531.329257
Energy at 298.15K
HF Energy	-530.653456
Nuclear repulsion energy	153.365988

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3701	3701
2	A	3557	3557
3	A	3160	3160
4	A	3081	3081
5	A	3012	3012
6	A	1641	1641
7	A	1466	1466
8	A	1463	1463
9	A	1391	1391
10	A	1368	1368
11	A	1321	1321
12	A	1016	1016
13	A	1010	1010
14	A	989	989
15	A	722	722
16	A	600	600
17	A	495	495
18	A	416	416
19	A	370	370
20	A	272	272
21	A	29	29

Atom	x (Å)	y (Å)	z (Å)
C1	0.282	0.057	0.000
S2	-1.382	-0.116	-0.000
C3	1.251	-1.117	-0.000
N4	0.888	1.278	0.000
H5	0.693	-2.063	0.001
H6	1.898	-1.073	-0.896
H7	1.899	-1.073	0.896
H8	1.898	1.368	-0.002
H9	0.317	2.115	-0.001

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6732	1.5224	1.3626	2.1595	2.1665	2.1664	2.0812	2.0577
S2	1.6732		2.8167	2.6645	2.8450	3.5325	3.5330	3.6008	2.8045
C3	1.5224	2.8167		2.4216	1.0980	1.1064	1.1064	2.5682	3.3639
N4	1.3626	2.6645	2.4216		3.3458	2.7110	2.7102	1.0138	1.0139
H5	2.1595	2.8450	1.0980	3.3458		1.7987	1.7987	3.6365	4.1943
H6	2.1665	3.5325	1.1064	2.7110	1.7987		1.7921	2.6005	3.6696
H7	2.1664	3.5330	1.1064	2.7102	1.7987	1.7921		2.6006	3.6695
H8	2.0812	3.6008	2.5682	1.0138	3.6365	2.6005	2.6006		1.7487
H9	2.0577	2.8045	3.3639	1.0139	4.1943	3.6696	3.6695	1.7487

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	109.937	C1	C3	H6	109.994
C1	C3	H7	109.990	C1	N4	H8	121.579
C1	N4	H9	119.239	S2	C1	C3	123.564
S2	C1	N4	122.399	C3	C1	N4	114.037
H5	C3	H6	109.364	H5	C3	H7	109.365
H6	C3	H7	108.161	H8	N4	H9	119.182

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: QCISD(T)/daug-cc-pVDZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3CSNH2 (Ethanethioamide)

using model chemistry: QCISD(T)/daug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)